In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 18 | Yes |
Popular Name: (2S)-2-(4-acetyl-1,4-diazepane-1-carbonyl)-3-methyl-butanenitrile (2S)-2-(4-acetyl-1,4-diazepane-1…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.22 | 5.78 | -13.96 | 0 | 5 | 0 | 64 | 251.33 | 2 | ↓ |